SCHEMBL6072397

SCHEMBL6072397

O=C(Nc1cnc2ccccc2c1)C1CCN(c2ccc(-c3ccccc3)cc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.68
EPHX2 P34913 1/20 0.56
ME3 Q16798 1/20 0.55
HSD17B10 Q99714 3/20 0.51
KDM4E B2RXH2 3/20 0.51
NPC1 O15118 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
RAB9A P51151 3/20 0.50
TP53 P04637 1/20 0.50
MAPT P10636 2/20 0.49
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
KMT2A Q03164 1/20 0.49
CYP46A1 Q9Y6A2 1/20 0.49
JAK2 O60674 1/20 0.49
KDR P35968 1/20 0.49
F10 P00742 1/20 0.48
MALT1 Q9UDY8 1/20 0.48
HCAR2 Q8TDS4 1/20 0.48
DEGS1 O15121 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5802659 0.93 TRPV1 (0.76) TRPV1EPHX2ME3HSD17B10KDM4E
SCHEMBL5802992 0.93 TRPV1 (0.75) TRPV1EPHX2ME3HSD17B10KDM4E
SCHEMBL5799801 0.87 TRPV1 (0.82) TRPV1EPHX2ME3MAPTMEN1
SCHEMBL5802548 0.85 TRPV1 (0.68) TRPV1EPHX2ME3HSD17B10KDM4E
SCHEMBL6072388 0.82 TRPV1 (0.64) TRPV1EPHX2ME3HSD17B10KDM4E
SCHEMBL5802617 0.81 TRPV1 (1.00) TRPV1EPHX2HSD17B10KDM4ESMN1; SMN2
SCHEMBL5802498 0.81 TRPV1 (0.62) TRPV1EPHX2HSD17B10KDM4ENPC1
SCHEMBL845869 0.81 KDR (0.64) TRPV1HSD17B10KDM4ENPC1SMN1; SMN2
SCHEMBL23360626 0.79 EPHX2 (0.59) TRPV1EPHX2HSD17B10KDM4ENPC1
SCHEMBL23360653 0.79 EPHX2 (0.59) TRPV1EPHX2HSD17B10KDM4ENPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060116368-A1 4-Piperidinecarboxamide modulators of vanilloid VR1 receptor JANSSEN PHARMACEUTICA N.V. (BE) 2006-06-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060116368-A1 4-Piperidinecarboxamide modulators of vanilloid VR1 receptor VDAC1, TRPV1, HVCN1 TRPV1 2/4885EPHX2 3203/4885ME3 2330/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.